[1-(2,4-dichlorophenyl)-2-imidazol-1-yl-ethyl] 4-tert-butylbenzoate

Systemtic Name: [1-(2,4-dichlorophenyl)-2-imidazol-1-yl-ethyl] 4-tert-butylbenzoate Openeye Name: [1-(2,4-dichlorophenyl)-2-imidazol-1-yl-ethyl] 4-tert-butylbenzoate CAS Name: 4-tert-butylbenzoic acid [1-(2,4-dichlorophenyl)-2-(1-imidazolyl)ethyl] ester IUPAC Name: [1-(2,4-dichlorophenyl)-2-imidazol-1-ylethyl] 4-tert-butylbenzoate Traditional Name: 4-tert-butylbenzoic acid [1-(2,4-dichlorophenyl)-2-imidazol-1-yl-ethyl] ester Formula: C22H22Cl2N2O2 MolecularWeight: 417.32828

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)OC(CN2C=CN=C2)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)OC(CN2C=CN=C2)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C22H22Cl2N2O2/c1-22(2,3)16-6-4-15(5-7-16)21(27)28-20(13-26-11-10-25-14-26)18-9-8-17(23)12-19(18)24/h4-12,14,20H,13H2,1-3H3